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Methyl 5-Ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetate
SpectraBase Compound ID BESaSyRIplH
InChI InChI=1S/C25H30N2O4S/c1-4-18-17-26(2)23(15-20(18)16-25(28)31-3)24-14-19-10-8-9-13-22(19)27(24)32(29,30)21-11-6-5-7-12-21/h5-14,18,20,23H,4,15-17H2,1-3H3
InChIKey HFJFBGBBEQNCBW-UHFFFAOYSA-N
Mol Weight 454.59 g/mol
Molecular Formula C25H30N2O4S
Exact Mass 454.192629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TXyeDBODsS
Name Methyl 5-Ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetate
Alternate Name(s) Methyl 5-Ethyl-1-methyl-2-[1-(phenylsulfonyl)-2-indolyl]-piperidine-4-acetates Methyl {5-ethyl-1-methyl-2-[1-(phenylsulfonyl)-1H-indol-2-yl]-4-piperidinyl}acetate
CAS Registry Number 132242-03-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N2O4S
InChI InChI=1S/C25H30N2O4S/c1-4-18-17-26(2)23(15-20(18)16-25(28)31-3)24-14-19-10-8-9-13-22(19)27(24)32(29,30)21-11-6-5-7-12-21/h5-14,18,20,23H,4,15-17H2,1-3H3
InChIKey HFJFBGBBEQNCBW-UHFFFAOYSA-N
Molecular Weight 454.585 g/mol
SMILES c1(S([n]2c(C3N(CC(C(C3)CC(=O)OC)CC)C)cc3c2cccc3)(=O)=O)ccccc1
SPLASH splash10-004i-9703000000-52bcb4d9362d82f70361
Source of Spectrum F-46-4400-10
Wiley ID 1388768